CHEBI:100048 - LSM-11427

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name LSM-11427
ChEBI ID CHEBI:100048
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C21H23N3O3
Net Charge 0
Average Mass 365.426
Monoisotopic Mass 365.17394
InChI InChI=1S/C21H23N3O3/c25-12-15-16-11-24-17(6-3-7-18(24)26)20(22-16)19(15)21(27)23-9-8-13-4-1-2-5-14(13)10-23/h1-7,15-16,19-20,22,25H,8-12H2/t15-,16-,19+,20+/m0/s1
InChIKey WCVQZBWBNHVCOB-XAMWDVODSA-N
SMILES C1CN(CC2=CC=CC=C21)C(=O)[C@@H]3[C@H]([C@@H]4CN5C(=O)C=CC=C5[C@H]3N4)CO
ChEBI Ontology
Outgoing LSM-11427 (CHEBI:100048) has functional parent β-amino acid (CHEBI:33706)
LSM-11427 (CHEBI:100048) is a organonitrogen compound (CHEBI:35352)
LSM-11427 (CHEBI:100048) is a organooxygen compound (CHEBI:36963)
Manual Xref Database
LSM-11427 LINCS
View more database links